3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(cyclododecylcarbamothioyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(cyclododecylcarbamothioyl)propanamide Openeye Name: N-(cyclododecylcarbamothioyl)-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[(cyclododecylamino)-sulfanylidenemethyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(cyclododecylcarbamothioyl)-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(cyclododecylthiocarbamoyl)-3-phthalimido-propionamide Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCCCC(CCCCC1)NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C24H33N3O3S/c28-21(16-17-27-22(29)19-14-10-11-15-20(19)23(27)30)26-24(31)25-18-12-8-6-4-2-1-3-5-7-9-13-18/h10-11,14-15,18H,1-9,12-13,16-17H2,(H2,25,26,28,31)